5408-2463 Screening compound: 3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid

5408-2463 Screening compound: 3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid
5408-2463 Screening compound: 3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-2463
3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

5408-2463

Molecular Formula

C19H16BrNO2 (C19 H16 BrNO2)

Compound Name

3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid

IUPAC name

3-[1-(4-bromophenyl)-5-phenyl-1H-pyrrol-2-yl]propanoic acid

SMILES

OC(CCc1ccc(-c2ccccc2)n1-c(cc1)ccc1Br)=O

InChI

InChI=1S/C19H16BrNO2/c20-15-6-8-16(9-7-15)21-17(11-13-19(22)23)10-12-18(21)14-4-2-1-3-5-14/h1-10,12H,11,13H2,(H,22,23)

InChI Key

HMZXHGRXGNBHAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03706744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.25

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.994

Distribution Coefficient, logD

2.180

Water Solubility, LogSw

-4.66

Polar Surface Area

29.779

Acid Dissociation Constant (pKa)

4.59

Base Dissociation Constant (pKb)

-1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

5408-2463 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 5408-2463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-2463?
Check Price and Availability of 5408-2463, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5408-2463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-2463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-2463
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 5408-2463 available by request